Information card for entry 7241918

Structure parameters

• Formula: C6 H0 I7 N4 Pb2
• Calculated formula: C6 I7 N4 Pb2
• Title of publication: Exploration of two-dimensional perovskites incorporating methylammonium for high performance solar cells
• Authors of publication: Jung, Mi-Hee
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 5
• Pages of publication: 1181 - 1200
• a: 45.458 ± 0.004 Å
• b: 8.9432 ± 0.0008 Å
• c: 8.8219 ± 0.0007 Å
• α: 90°
• β: 98.251 ± 0.006°
• γ: 90°
• Cell volume: 3549.3 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.156
• Residual factor for significantly intense reflections: 0.0983
• Weighted residual factors for significantly intense reflections: 0.294
• Weighted residual factors for all reflections included in the refinement: 0.3364
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No